3-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-4-naphthalen-1-yl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-4-naphthalen-1-yl-1H-1,2,4-triazole-5-thione Openeye Name: 3-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-4-(1-naphthyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-4-(1-naphthalenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-4-naphthalen-1-yl-1H-1,2,4-triazole-5-thione Traditional Name: 3-[3-(4-methoxyphenyl)-1H-pyrazol-5-yl]-4-(1-naphthyl)-1H-1,2,4-triazole-5-thione Formula: C22H17N5OS MolecularWeight: 399.46828

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NNC(=C2)C3=NNC(=S)N3C4=CC=CC5=CC=CC=C54

Isomeric SMILES

COC1=CC=C(C=C1)C2=NNC(=C2)C3=NNC(=S)N3C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C22H17N5OS/c1-28-16-11-9-15(10-12-16)18-13-19(24-23-18)21-25-26-22(29)27(21)20-8-4-6-14-5-2-3-7-17(14)20/h2-13H,1H3,(H,23,24)(H,26,29)